5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine

C16H25N3O2 — CID 79501421

IUPAC5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine
SMILESCOc1cccc(N2C(N)=NCC2(C)CC(C)(C)OC)c1
InChIInChI=1S/C16H25N3O2/c1-15(2,21-5)10-16(3)11-18-14(17)19(16)12-7-6-8-13(9-12)20-4/h6-9H,10-11H2,1-5H3,(H2,17,18)
InChIKeyUWQFQDDLWGABKB-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.40
Rot. Bonds5

About 5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine

5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine (PubChem CID 79501421) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is 5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine
PubChem CID79501421
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC Name5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine
SMILESCOc1cccc(N2C(N)=NCC2(C)CC(C)(C)OC)c1
InChIInChI=1S/C16H25N3O2/c1-15(2,21-5)10-16(3)11-18-14(17)19(16)12-7-6-8-13(9-12)20-4/h6-9H,10-11H2,1-5H3,(H2,17,18)
InChIKeyUWQFQDDLWGABKB-UHFFFAOYSA-N
XLogP2.40
TPSA60.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

GNF-Pf-4467
CID 6602963
1-(3-Methoxyphenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine
CID 427328
N,N''-Bis-(3-methoxy-phenyl)-guanidine
CID 10016031
1-(3-Ethoxyphenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine
CID 16073789
4,6-NH2 2,2-Dime-1-(3-buo PH)S-triazine
CID 23275698
Urea, 1-(m-methoxyphenyl)-3-(1-methyl-2-pyrrolidinylidene)-
CID 9554218
6,6-Dimethyl-1-[3-(2-phenoxyethoxy)phenyl]-1,3,5-triazine-2,4-diamine
CID 427333
1-(3,4-Dimethoxyphenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine
CID 3563970
1-(3-(Hexyloxy)phenyl)-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine
CID 16073792
6,6-Dimethyl-1-[3-(4-phenoxybutoxy)phenyl]-1,3,5-triazine-2,4-diamine
CID 16073810
6,6-Dimethyl-1-[3-(pentyloxy)phenyl]-1,6-dihydro-1,3,5-triazine-2,4-diamine
CID 44280828
1-(3,4-Dimethoxyphenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine;hydrochloride
CID 44522078

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine?
The IUPAC name of 5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine (CID 79501421) is 5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine.
What is the SMILES notation for 5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine?
The canonical SMILES for 5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine is COc1cccc(N2C(N)=NCC2(C)CC(C)(C)OC)c1.
What is the InChIKey of 5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine?
The InChIKey is UWQFQDDLWGABKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-15(2,21-5)10-16(3)11-18-14(17)19(16)12-7-6-8-13(9-12)20-4/h6-9H,10-11H2,1-5H3,(H2,17,18).
What are the key properties of 5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine?
5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine has a molecular weight of 291.39 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxy-2-methylpropyl)-1-(3-methoxyphenyl)-5-methyl-4H-imidazol-2-amine is sourced from PubChem (CID 79501421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).